Molecule ID: SM26

SMILES: CC(=O)NS(=O)(=O)CCc1ccccc1

InChI: InChI=1S/C10H13NO3S/c1-9(12)11-15(13,14)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,11,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.91 SAMPL7 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization